Home Other Building Blocks 1-PHENYLPROPANE-2-SULFONYL CHLORIDE

1-PHENYLPROPANE-2-SULFONYL CHLORIDE

CAS No.:
76653-18-4
Catalog Number:
AG01B31W
Molecular Formula:
C9H11ClO2S
Molecular Weight:
218.7004
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Product Description
Catalog Number:
AG01B31W
Chemical Name:
1-PHENYLPROPANE-2-SULFONYL CHLORIDE
CAS Number:
76653-18-4
Molecular Formula:
C9H11ClO2S
Molecular Weight:
218.7004
MDL Number:
MFCD09886677
IUPAC Name:
1-phenylpropane-2-sulfonyl chloride
InChI:
InChI=1S/C9H11ClO2S/c1-8(13(10,11)12)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3
InChI Key:
MVNNQZOLPSWUGV-UHFFFAOYSA-N
SMILES:
CC(S(=O)(=O)Cl)Cc1ccccc1
Properties
Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.017g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.695g/mol
Monoisotopic Mass:
218.017g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties